N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
Chemical Structure Depiction of
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
Compound characteristics
| Compound ID: | C270-0239 |
| Compound Name: | N-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C20 H24 Cl N5 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CCNC(Nc2ccc(cc2)[N+]([O-])=O)=O)CC1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.141 |
| logD: | 2.584 |
| logSw: | -4.4211 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.029 |
| InChI Key: | PVJXGDUGJIFOTF-UHFFFAOYSA-N |